
#######################################################
#                                                     #
#                        LGA                          #
#                  ---------------                    #
#                                                     #
#               Local-Global Alignment                #
#        A Method for Finding 3-D Similarities        #
#               in Protein Structures                 #
#                                                     #
#                  ------------ 10/2009               #
#                                                     #
#      Adam Zemla (adamz@llnl.gov)                    #
#      Lawrence Livermore National Laboratory, CA     #
#                                                     #
#######################################################

!!!   License for LGA program has expired  !!!
#   For updated version of the LGA program   #
# please contact Adam Zemla:  adamz@llnl.gov #

# Molecule1: number of CA atoms  134 ( 1091),  selected  132 , name one
# Molecule2: number of CA atoms  132 ( 1073),  selected  132 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:A  -ch2:A  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   132       3_A - 134_A       0.75     0.75
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   132       3_A - 134_A       0.75     0.75
  LCS_AVERAGE:    100.00

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   132       3_A - 134_A       0.75     0.75
  LCS_AVERAGE:    100.00

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  132
LCS_GDT     RESIDUE       RESIDUE       SEGMENT_SIZE    GLOBAL DISTANCE TEST COLUMNS: number of residues under the threshold assigned to each residue pair
LCS_GDT   NAME NUMBER   NAME NUMBER    1.0  2.0  5.0    0.5  1.0  1.5  2.0  2.5  3.0  3.5  4.0  4.5  5.0  5.5  6.0  6.5  7.0  7.5  8.0  8.5  9.0  9.5 10.0
LCS_GDT     D     3_A     D     3_A    132  132  132      3    6   43  104  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     V     4_A     V     4_A    132  132  132     32  106  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     D     5_A     D     5_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     K     6_A     K     6_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     R     7_A     R     7_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     K     8_A     K     8_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     I     9_A     I     9_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     K    10_A     K    10_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     I    11_A     I    11_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     I    12_A     I    12_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     L    13_A     L    13_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     N    14_A     N    14_A    132  132  132      6   21  122  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     G    15_A     G    15_A    132  132  132     33  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     E    16_A     E    16_A    132  132  132     62  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     M    17_A     M    17_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     E    18_A     E    18_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     E    19_A     E    19_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     A    20_A     A    20_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     E    21_A     E    21_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     L    22_A     L    22_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     H    23_A     H    23_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     M    24_A     M    24_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     I    25_A     I    25_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     T    26_A     T    26_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     S    27_A     S    27_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     P    28_A     P    28_A    132  132  132      3   71  124  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     N    29_A     N    29_A    132  132  132      3  111  124  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     R    30_A     R    30_A    132  132  132      3   29  124  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     H    31_A     H    31_A    132  132  132     74  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     C    32_A     C    32_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     C    33_A     C    33_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     L    34_A     L    34_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     K    35_A     K    35_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     I    36_A     I    36_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     F    37_A     F    37_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     H    38_A     H    38_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     N    39_A     N    39_A    132  132  132     75  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     N    40_A     N    40_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     N    41_A     N    41_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     Q    42_A     Q    42_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     L    43_A     L    43_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     A    44_A     A    44_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     E    45_A     E    45_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     S    46_A     S    46_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     N    47_A     N    47_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     D    48_A     D    48_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     T    49_A     T    49_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     D    50_A     D    50_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     Y    51_A     Y    51_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     F    52_A     F    52_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     S    53_A     S    53_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     C    54_A     C    54_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     F    55_A     F    55_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     A    56_A     A    56_A    132  132  132     73  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     D    57_A     D    57_A    132  132  132     75  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     L    58_A     L    58_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     R    59_A     R    59_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     N    60_A     N    60_A    132  132  132     75  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     Q    61_A     Q    61_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     L    62_A     L    62_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     K    63_A     K    63_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     N    64_A     N    64_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     I    65_A     I    65_A    132  132  132     81  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     I    66_A     I    66_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     F    67_A     F    67_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     L    68_A     L    68_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     C    69_A     C    69_A    132  132  132     53  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     K    70_A     K    70_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     G    71_A     G    71_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     A    72_A     A    72_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     K    73_A     K    73_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     I    74_A     I    74_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     N    75_A     N    75_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     V    76_A     V    76_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     Y    77_A     Y    77_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     P    78_A     P    78_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     S    79_A     S    79_A    132  132  132     73  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     A    80_A     A    80_A    132  132  132     45  107  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     M    81_A     M    81_A    132  132  132     45  107  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     S    82_A     S    82_A    132  132  132     45  107  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     R    83_A     R    83_A    132  132  132     37  105  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     D    84_A     D    84_A    132  132  132     37   98  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     M    85_A     M    85_A    132  132  132     37   99  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     S    86_A     S    86_A    132  132  132     14  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     D    87_A     D    87_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     G    88_A     G    88_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     I    89_A     I    89_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     V    90_A     V    90_A    132  132  132     23  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     A    91_A     A    91_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     Y    92_A     Y    92_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     E    93_A     E    93_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     T    94_A     T    94_A    132  132  132     78  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     T    95_A     T    95_A    132  132  132     58  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     L    96_A     L    96_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     G    97_A     G    97_A    132  132  132     33  110  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     Q    98_A     Q    98_A    132  132  132     16  104  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     P    99_A     P    99_A    132  132  132     12  104  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     G   100_A     G   100_A    132  132  132     80  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     L   101_A     L   101_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     P   102_A     P   102_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     E   103_A     E   103_A    132  132  132     76  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     N   104_A     N   104_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     Q   105_A     Q   105_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     V   106_A     V   106_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     H   107_A     H   107_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     I   108_A     I   108_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     F   109_A     F   109_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     D   110_A     D   110_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     F   111_A     F   111_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     E   112_A     E   112_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     D   113_A     D   113_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     K   114_A     K   114_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     Y   115_A     Y   115_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     V   116_A     V   116_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     D   117_A     D   117_A    132  132  132     71  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     I   118_A     I   118_A    132  132  132     78  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     T   119_A     T   119_A    132  132  132     78  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     P   120_A     P   120_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     E   121_A     E   121_A    132  132  132     78  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     E   122_A     E   122_A    132  132  132     78  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     Q   123_A     Q   123_A    132  132  132     83  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     R   124_A     R   124_A    132  132  132     79  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     K   125_A     K   125_A    132  132  132     58  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     F   126_A     F   126_A    132  132  132     79  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     H   127_A     H   127_A    132  132  132     78  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     S   128_A     S   128_A    132  132  132     58  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     Q   129_A     Q   129_A    132  132  132     53  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     W   130_A     W   130_A    132  132  132     53  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     F   131_A     F   131_A    132  132  132     58  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     E   132_A     E   132_A    132  132  132     58  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     S   133_A     S   133_A    132  132  132     58  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_GDT     L   134_A     L   134_A    132  132  132     58  116  127  131  131  132  132  132  132  132  132  132  132  132  132  132  132  132  132  132 
LCS_AVERAGE  LCS_A: 100.00  ( 100.00  100.00  100.00 )

GLOBAL_DISTANCE_TEST (summary information about detected largest sets of residues (represented by selected AToms) that can fit under specified thresholds)
GDT DIST_CUTOFF  0.50   1.00   1.50   2.00   2.50   3.00   3.50   4.00   4.50   5.00   5.50   6.00   6.50   7.00   7.50   8.00   8.50   9.00   9.50  10.00
GDT NUMBER_AT     83    116    127    131    131    132    132    132    132    132    132    132    132    132    132    132    132    132    132    132 
GDT PERCENT_AT  62.88  87.88  96.21  99.24  99.24 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00 100.00
GDT RMS_LOCAL    0.32   0.48   0.61   0.70   0.70   0.75   0.75   0.75   0.75   0.75   0.75   0.75   0.75   0.75   0.75   0.75   0.75   0.75   0.75   0.75
GDT RMS_ALL_AT   0.77   0.75   0.76   0.75   0.75   0.75   0.75   0.75   0.75   0.75   0.75   0.75   0.75   0.75   0.75   0.75   0.75   0.75   0.75   0.75

# Checking swapping
#   possible swapping detected:  D     5_A      D     5_A
#   possible swapping detected:  E    18_A      E    18_A
#   possible swapping detected:  F    37_A      F    37_A
#   possible swapping detected:  E    45_A      E    45_A
#   possible swapping detected:  F    52_A      F    52_A
#   possible swapping detected:  F    55_A      F    55_A
#   possible swapping detected:  F    67_A      F    67_A
#   possible swapping detected:  Y    77_A      Y    77_A
#   possible swapping detected:  D    87_A      D    87_A
#   possible swapping detected:  Y    92_A      Y    92_A
#   possible swapping detected:  E    93_A      E    93_A
#   possible swapping detected:  E   103_A      E   103_A
#   possible swapping detected:  F   111_A      F   111_A
#   possible swapping detected:  E   112_A      E   112_A
#   possible swapping detected:  E   122_A      E   122_A
#   possible swapping detected:  E   132_A      E   132_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    D     3_A      D     3_A     3.075     3    0.052   0.052     4.291   59.167   34.226
LGA    V     4_A      V     4_A     1.226     0    0.145   0.222     2.290   75.119   75.374
LGA    D     5_A      D     5_A     0.103     0    0.034   0.884     3.085  100.000   83.095
LGA    K     6_A      K     6_A     0.255     0    0.103   0.362     1.548  100.000   95.926
LGA    R     7_A      R     7_A     0.187     0    0.047   1.055     3.793  100.000   79.048
LGA    K     8_A      K     8_A     0.422     0    0.013   0.433     2.272   95.238   85.767
LGA    I     9_A      I     9_A     0.550     0    0.086   1.146     2.644   92.857   81.071
LGA    K    10_A      K    10_A     0.349     0    0.025   0.897     3.867  100.000   84.550
LGA    I    11_A      I    11_A     0.201     0    0.024   0.050     0.403  100.000  100.000
LGA    I    12_A      I    12_A     0.252     0    0.052   0.082     0.750   97.619   96.429
LGA    L    13_A      L    13_A     0.410     0    0.124   1.016     2.481   92.976   87.679
LGA    N    14_A      N    14_A     2.006     0    0.104   0.160     3.826   70.833   60.476
LGA    G    15_A      G    15_A     0.822     0    0.026   0.026     1.186   90.595   90.595
LGA    E    16_A      E    16_A     0.654     0    0.065   0.834     2.725   95.238   83.069
LGA    M    17_A      M    17_A     0.561     0    0.063   0.672     1.916   88.214   83.750
LGA    E    18_A      E    18_A     0.485     0    0.042   0.775     1.893  100.000   93.862
LGA    E    19_A      E    19_A     0.377     0    0.028   0.187     1.150   97.619   92.646
LGA    A    20_A      A    20_A     0.159     0    0.039   0.062     0.408  100.000  100.000
LGA    E    21_A      E    21_A     0.211     0    0.011   0.415     1.124  100.000   96.878
LGA    L    22_A      L    22_A     0.059     0    0.055   0.086     0.315  100.000  100.000
LGA    H    23_A      H    23_A     0.153     0    0.052   0.114     0.354  100.000  100.000
LGA    M    24_A      M    24_A     0.233     0    0.020   1.001     3.386  100.000   92.560
LGA    I    25_A      I    25_A     0.349     0    0.012   0.355     0.985  100.000   97.619
LGA    T    26_A      T    26_A     0.260     0    0.030   0.071     0.640  100.000   98.639
LGA    S    27_A      S    27_A     0.409     0    0.035   0.717     3.987   92.976   82.778
LGA    P    28_A      P    28_A     1.997     0    0.636   0.585     4.743   60.714   68.503
LGA    N    29_A      N    29_A     1.640     0    0.099   1.122     2.587   75.000   73.095
LGA    R    30_A      R    30_A     1.827     0    0.086   0.653     3.628   75.000   62.424
LGA    H    31_A      H    31_A     0.755     0    0.079   1.536     6.866   97.619   60.619
LGA    C    32_A      C    32_A     0.166     0    0.042   0.055     0.392  100.000  100.000
LGA    C    33_A      C    33_A     0.171     0    0.051   0.079     0.285  100.000  100.000
LGA    L    34_A      L    34_A     0.148     0    0.015   0.069     0.244  100.000  100.000
LGA    K    35_A      K    35_A     0.171     0    0.021   0.132     0.836  100.000   98.942
LGA    I    36_A      I    36_A     0.150     0    0.015   0.108     0.540  100.000   98.810
LGA    F    37_A      F    37_A     0.092     0    0.014   0.065     0.343  100.000  100.000
LGA    H    38_A      H    38_A     0.251     0    0.019   0.065     0.517   97.619   99.048
LGA    N    39_A      N    39_A     0.699     0    0.020   1.126     3.276   90.476   83.155
LGA    N    40_A      N    40_A     0.487     0    0.070   1.026     2.251   95.238   87.619
LGA    N    41_A      N    41_A     0.527     0    0.017   0.974     4.622   97.619   77.440
LGA    Q    42_A      Q    42_A     0.443     0    0.029   0.112     0.734   97.619   98.942
LGA    L    43_A      L    43_A     0.328     0    0.055   0.296     1.592   97.619   93.036
LGA    A    44_A      A    44_A     0.431     0    0.019   0.020     0.456  100.000  100.000
LGA    E    45_A      E    45_A     0.342     0    0.053   0.474     2.046  100.000   88.995
LGA    S    46_A      S    46_A     0.482     0    0.052   0.600     2.256   95.238   89.365
LGA    N    47_A      N    47_A     0.082     0    0.012   0.112     0.292  100.000  100.000
LGA    D    48_A      D    48_A     0.189     0    0.050   0.089     0.606  100.000   97.619
LGA    T    49_A      T    49_A     0.455     0    0.116   0.114     0.918  100.000   97.279
LGA    D    50_A      D    50_A     0.400     0    0.043   0.209     0.512  100.000   98.810
LGA    Y    51_A      Y    51_A     0.317     0    0.031   0.105     1.178   97.619   95.278
LGA    F    52_A      F    52_A     0.534     0    0.010   0.035     0.677   92.857   91.342
LGA    S    53_A      S    53_A     0.577     0    0.033   0.082     0.743   90.476   90.476
LGA    C    54_A      C    54_A     0.497     0    0.030   0.041     0.588   95.238   96.825
LGA    F    55_A      F    55_A     0.432     0    0.034   0.221     1.296  100.000   93.203
LGA    A    56_A      A    56_A     0.774     0    0.038   0.039     1.065   90.476   88.667
LGA    D    57_A      D    57_A     0.737     0    0.026   0.899     2.790   90.476   82.976
LGA    L    58_A      L    58_A     0.358     0    0.014   1.291     3.248  100.000   88.036
LGA    R    59_A      R    59_A     0.500     0    0.030   0.665     2.468   95.238   85.108
LGA    N    60_A      N    60_A     0.704     0    0.044   0.903     3.082   90.476   80.000
LGA    Q    61_A      Q    61_A     0.402     0    0.121   0.213     0.554   95.238   96.825
LGA    L    62_A      L    62_A     0.305     0    0.059   0.059     0.375  100.000  100.000
LGA    K    63_A      K    63_A     0.302     0    0.020   0.627     1.900  100.000   94.868
LGA    N    64_A      N    64_A     0.279     0    0.019   1.111     4.299  100.000   79.702
LGA    I    65_A      I    65_A     0.560     0    0.063   0.090     0.654   90.476   90.476
LGA    I    66_A      I    66_A     0.479     0    0.029   0.065     0.703  100.000   95.238
LGA    F    67_A      F    67_A     0.228     0    0.012   0.083     0.974  100.000   96.537
LGA    L    68_A      L    68_A     0.319     0    0.064   0.075     0.545  100.000   98.810
LGA    C    69_A      C    69_A     0.558     0    0.058   0.748     2.515   92.857   86.508
LGA    K    70_A      K    70_A     0.403     0    0.026   0.049     0.732  100.000   96.825
LGA    G    71_A      G    71_A     0.378     0    0.008   0.008     0.396  100.000  100.000
LGA    A    72_A      A    72_A     0.305     0    0.031   0.030     0.339  100.000  100.000
LGA    K    73_A      K    73_A     0.273     0    0.020   0.126     0.686  100.000   98.942
LGA    I    74_A      I    74_A     0.275     0    0.035   0.259     0.950  100.000   97.619
LGA    N    75_A      N    75_A     0.290     0    0.028   0.122     0.925   97.619   95.238
LGA    V    76_A      V    76_A     0.340     0    0.066   0.107     0.592   97.619   95.918
LGA    Y    77_A      Y    77_A     0.419     0    0.046   0.335     1.178  100.000   95.278
LGA    P    78_A      P    78_A     0.443     0    0.067   0.306     1.154   92.976   91.905
LGA    S    79_A      S    79_A     1.056     0    0.047   0.063     1.175   83.690   82.937
LGA    A    80_A      A    80_A     1.503     0    0.017   0.025     1.744   79.286   78.000
LGA    M    81_A      M    81_A     1.491     0    0.018   0.736     2.221   81.429   76.131
LGA    S    82_A      S    82_A     1.411     0    0.044   0.670     1.518   81.429   80.000
LGA    R    83_A      R    83_A     1.463     0    0.031   0.753     1.843   81.429   79.913
LGA    D    84_A      D    84_A     1.529     0    0.081   0.809     3.838   72.857   64.345
LGA    M    85_A      M    85_A     1.597     0    0.038   1.043     4.715   77.143   65.119
LGA    S    86_A      S    86_A     0.997     0    0.034   0.686     2.807   88.214   81.905
LGA    D    87_A      D    87_A     0.303     0    0.081   0.206     0.653   97.619   96.429
LGA    G    88_A      G    88_A     0.228     0    0.065   0.065     0.344  100.000  100.000
LGA    I    89_A      I    89_A     0.201     0    0.064   1.573     4.711  100.000   80.714
LGA    V    90_A      V    90_A     0.807     0    0.073   1.017     2.290   90.476   83.129
LGA    A    91_A      A    91_A     0.527     0    0.081   0.144     0.770   90.476   90.476
LGA    Y    92_A      Y    92_A     0.612     0    0.031   0.152     1.130   95.238   91.349
LGA    E    93_A      E    93_A     0.146     0    0.049   0.773     2.074   95.238   84.815
LGA    T    94_A      T    94_A     0.617     0    0.033   0.045     0.826   95.238   93.197
LGA    T    95_A      T    95_A     0.665     0    0.032   0.053     1.077   90.476   89.184
LGA    L    96_A      L    96_A     0.255     0    0.045   1.400     5.083   92.976   73.571
LGA    G    97_A      G    97_A     1.361     0    0.017   0.017     1.948   79.405   79.405
LGA    Q    98_A      Q    98_A     1.377     0    0.034   0.152     1.711   81.429   78.571
LGA    P    99_A      P    99_A     1.330     0    0.095   0.330     1.651   85.952   82.789
LGA    G   100_A      G   100_A     0.516     0    0.064   0.064     0.902   95.238   95.238
LGA    L   101_A      L   101_A     0.256     0    0.027   0.057     0.581  100.000   98.810
LGA    P   102_A      P   102_A     0.626     0    0.057   0.070     0.873   92.857   91.837
LGA    E   103_A      E   103_A     0.603     0    0.018   0.360     0.862   92.857   93.651
LGA    N   104_A      N   104_A     0.218     0    0.042   0.213     0.573  100.000   98.810
LGA    Q   105_A      Q   105_A     0.353     0    0.115   0.759     2.595   97.619   89.947
LGA    V   106_A      V   106_A     0.315     0    0.017   0.038     0.630   97.619   95.918
LGA    H   107_A      H   107_A     0.424     0    0.037   0.120     1.012  100.000   94.333
LGA    I   108_A      I   108_A     0.398     0    0.015   0.075     0.438  100.000  100.000
LGA    F   109_A      F   109_A     0.429     0    0.030   0.070     0.463  100.000  100.000
LGA    D   110_A      D   110_A     0.347     0    0.034   0.167     0.985   97.619   95.238
LGA    F   111_A      F   111_A     0.217     0    0.054   0.097     0.505   97.619   99.134
LGA    E   112_A      E   112_A     0.436     0    0.055   0.272     1.381  100.000   91.693
LGA    D   113_A      D   113_A     0.430     0    0.041   0.156     0.780   95.238   94.048
LGA    K   114_A      K   114_A     0.292     0    0.073   0.899     3.499  100.000   86.614
LGA    Y   115_A      Y   115_A     0.442     0    0.014   0.342     2.647  100.000   82.143
LGA    V   116_A      V   116_A     0.220     0    0.052   0.073     0.548   97.619   98.639
LGA    D   117_A      D   117_A     0.667     0    0.337   1.289     4.544   84.048   73.452
LGA    I   118_A      I   118_A     0.604     0    0.064   0.213     0.888   92.857   92.857
LGA    T   119_A      T   119_A     0.630     0    0.010   0.116     0.730   95.238   93.197
LGA    P   120_A      P   120_A     0.503     0    0.021   0.034     0.663   90.476   90.476
LGA    E   121_A      E   121_A     0.623     0    0.037   0.819     2.735   90.476   81.111
LGA    E   122_A      E   122_A     0.593     0    0.048   0.307     1.169   90.476   89.471
LGA    Q   123_A      Q   123_A     0.371     0    0.021   0.177     0.635  100.000   98.942
LGA    R   124_A      R   124_A     0.497     0    0.035   0.145     0.624   95.238   93.939
LGA    K   125_A      K   125_A     0.613     0    0.016   1.263     5.450   90.476   73.280
LGA    F   126_A      F   126_A     0.487     0    0.026   0.175     0.909   92.857   94.805
LGA    H   127_A      H   127_A     0.540     0    0.043   0.190     0.720   90.476   95.238
LGA    S   128_A      S   128_A     0.839     0    0.034   0.105     0.990   90.476   90.476
LGA    Q   129_A      Q   129_A     0.899     0    0.022   0.192     1.712   90.476   83.545
LGA    W   130_A      W   130_A     0.841     0    0.024   0.080     0.911   90.476   91.837
LGA    F   131_A      F   131_A     0.918     0    0.028   1.127     4.689   85.952   70.952
LGA    E   132_A      E   132_A     1.081     0    0.020   0.186     1.415   81.429   81.429
LGA    S   133_A      S   133_A     1.077     0    0.037   0.070     1.301   81.429   84.444
LGA    L   134_A      L   134_A     1.124     0    0.680   0.550     1.329   81.429   81.429

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      132     528    528  100.00    1073   1073  100.00               132
SUMMARY(RMSD_GDC):     0.746          0.770                  1.230           93.609   89.025

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  134  132    4.0    132    0.75    96.780    98.658    15.604

LGA_LOCAL      RMSD:   0.746  Number of atoms:  132  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:   0.746  Number of assigned atoms:  132 
Std_ASGN_ATOMS RMSD:   0.746  Standard rmsd on all 132 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =  -0.773116 * X  +   0.319747 * Y  +   0.547771 * Z  + -12.333061
  Y_new =   0.630681 * X  +   0.295872 * Y  +   0.717426 * Z  +   9.677988
  Z_new =   0.067324 * X  +   0.900123 * Y  +  -0.430402 * Z  +  -0.423447 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  2.457313 -0.067375  2.016819   [DEG:  140.7936   -3.8603  115.5552 ]
ZXZ:  2.489493  2.015734  0.074656   [DEG:  142.6375  115.4931    4.2775 ]
 
# END of job
